Vitas-M small molecule compound
6-ethyl-6-methyl-12-(prop-2-en-1-yl)-9-(prop-2-en-1-ylsulfanyl)-6,12-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Catalog ID
STK556559
SMILES C=CCn1c2c3ccccc3CC(c2c(=O)n2c1nnc2SCC=C)(C)CC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H24N4OS MW 392.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4OS/c1-5-12-25-18-16-11-9-8-10-15(16)14-22(4,7-3)17(18)19(27)26-20(25)23-24-21(26)28-13-6-2/h5-6,8-11H,1-2,7,12-14H2,3-4H3InChIKey
WRBMWHURFAXIMO-UHFFFAOYSA-NSynonyms
577765-13-012allyl9(allylthio)6ethyl6methyl56dihydrobenzo(h)(124)triazolo(34b)quinazolin7(12H)one
577765130
6ethyl6methyl12(prop2en1yl)9(prop2en1ylsulfanyl)612dihydrobenzo(h)(124)triazolo(34b)quinazolin7(5H)one
CCC1(CC2=CC=CC=C2C3=C1C(=O)N4C(=NN=C4SCC=C)N3CC=C)C
InChI=1SC22H24N4OSc151225181611981015(16)1422(473)17(18)19(27)2620(25)232421(26)281362h56811H1271214H234H3
MFCD04018830
ZINC000005047398
ZINC000005047399
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